cyclopropyl-[(4-methoxyphenyl)methyl]-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(4-methyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: cyclopropyl-[(4-methyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-p-anisyl-ammonium Formula: C21H25N4OS+ MolecularWeight: 381.5144

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+](CC2=CC=C(C=C2)OC)C3CC3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+](CC2=CC=C(C=C2)OC)C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4OS/c1-23-20(17-6-4-3-5-7-17)22-25(21(23)27)15-24(18-10-11-18)14-16-8-12-19(26-2)13-9-16/h3-9,12-13,18H,10-11,14-15H2,1-2H3/p+1